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Home > Aldehydes > 1780193-24-9
1780193-24-9 | 7-fluoro-3,4-dihydro-2H-1,5-benzodioxepine-6-carbaldehyde
CAS No: 1780193-24-9 Catalog No: AG01C9PS MDL No:MFCD31453124
Product Description
Catalog Number:
AG01C9PS
Chemical Name:
7-fluoro-3,4-dihydro-2H-1,5-benzodioxepine-6-carbaldehyde
CAS Number:
1780193-24-9
Molecular Formula:
C10H9FO3
Molecular Weight:
196.1751
MDL Number:
MFCD31453124
IUPAC Name:
7-fluoro-3,4-dihydro-2H-1,5-benzodioxepine-6-carbaldehyde
InChI:
InChI=1S/C10H9FO3/c11-8-2-3-9-10(7(8)6-12)14-5-1-4-13-9/h2-3,6H,1,4-5H2
InChI Key:
AWQUJZXTFKLIGU-UHFFFAOYSA-N
SMILES:
O=Cc1c(F)ccc2c1OCCCO2
Properties
Complexity:
210
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
196.054g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
196.177g/mol
Monoisotopic Mass:
196.054g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
35.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
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